%chk=000076076.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076076

0 1
 S    1.904000     -0.5793000     -8.9400001E-02
 O   0.8671000       2.247900     -7.4000000E-03
 O    2.503600     -0.2191000       1.387500    
 O    1.922900      -2.028300     -0.2155000    
 O    2.573900      0.2616000      -1.068000    
 N   -3.131700      -1.618600      4.0000002E-03
 C   0.2324000     -6.6299997E-02 -4.0600002E-02
 C  -0.7744000      -1.031600     -3.7599999E-02
 C  -9.9799998E-02   1.288000     -4.9000001E-03
 C   -2.113400     -0.6428000      1.1000000E-03
 C   -1.438800       1.676900      3.4000002E-02
 C   -2.445600      0.7115000      3.6899999E-02
 H  -0.5362000      -2.091600     -6.2700003E-02
 H   -1.712500       2.728300      6.2100001E-02
 H   -3.485400       1.027200      6.7199998E-02
 H   -4.102600      -1.336800      3.2299999E-02
 H   -2.892200      -2.600800     -2.1700000E-02
 H   0.4460000       3.124100      2.0400001E-02
 H    2.072900     -0.6833000       2.143500    


%chk=000076076-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076076

0 1
S 1.899165 -0.832837 0.002640
O 1.028635 2.017297 0.449952
O 2.589247 -0.049106 1.517491
O 1.866274 -2.417771 0.294611
O 2.657720 -0.252282 -1.298919
N -3.303151 -1.570367 -0.228885
C 0.127601 -0.191497 0.067316
C -0.901548 -1.128564 -0.069026
C -0.094132 1.190917 0.209348
C -2.251011 -0.669630 -0.090424
C -1.430333 1.645686 0.193819
C -2.489928 0.732182 0.028792
H -0.654108 -2.193105 -0.149291
H -1.646840 2.713032 0.320971
H -3.519759 1.106561 0.011831
H -4.266742 -1.249955 -0.243143
H -3.128943 -2.567934 -0.307920
H 0.883372 2.947706 0.155537
H 2.424682 0.936669 1.376500


